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9,9-dioctylfluorene-2,7-diamine

9,9-dioctylfluorene-2,7-diamine

CAS: 851042-10-9

Formula: C29H44N2

SMILES: CCCCCCCCC1(CCCCCCCC)C2=C(C=CC(N)=C2)C2=C1C=C(N)C=C2

IUPAC: 9,9-dioctyl-9H-fluorene-2,7-diamine

InChI: InChI=1S/C29H44N2/c1-3-5-7-9-11-13-19-29(20-14-12-10-8-6-4-2)27-21-23(30)15-17-25(27)26-18-16-24(31)22-28(26)29/h15-18,21-22H,3-14,19-20,30-31H2,1-2H3

Composition: C (82.80%), H (10.54%), N (6.66%)

Molar Mass: 420.685

Atom Count: 75

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 420.350449425
Formal Charge 0
FSP3 0.59
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey ODJBGRHFVFWTBO-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 148.21
Topological Polar Surface Area 52.04
Polarizability 54.23
Ring Count 3
Rotatable Bond Count 14

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